PUBCHEM-ZINC05141743 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 0.8810 1.6910 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 0.1900 0.1690 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2790 -0.0220 -0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -0.5740 1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -2.0500 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -2.6840 0.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -4.0120 0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -5.1570 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -6.3580 0.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -6.3880 0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 -5.3620 1.4160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -4.1880 1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -2.9220 1.5760 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -2.5300 2.3230 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3620 -1.7510 1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -1.9850 3.7820 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9190 -0.9030 3.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 -2.6350 4.4600 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8460 -2.0010 4.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1050 -3.9420 3.7030 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3520 -4.6810 4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -3.6010 2.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4790 -4.5830 3.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4970 -5.7240 2.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 -5.4670 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 -2.8290 5.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 -2.7770 5.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 -2.4210 4.4110 O 0 5 0 0 0 0 0 0 0 0 0 0 2.5520 -5.1110 -0.9090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -0.2230 -0.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 -1.2080 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 1.9400 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 2.2180 -0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 2.0740 0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -0.4100 2.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -0.1910 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -7.3700 1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7150 -4.9100 4.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 -3.9020 3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -4.2230 -1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 -5.9760 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 28 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 29 40 1 0 0 0 0 29 41 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 28 -1 M END